N-[3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]methanesulfonamide

Systemtic Name: N-[3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]methanesulfonamide Openeye Name: N-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)methanesulfonamide CAS Name: N-[3-(phenylmethylthio)-1H-1,2,4-triazol-5-yl]methanesulfonamide IUPAC Name: N-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)methanesulfonamide Traditional Name: N-[3-(benzylthio)-1H-1,2,4-triazol-5-yl]methanesulfonamide Formula: C10H12N4O2S2 MolecularWeight: 284.35788

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=NC(=NN1)SCC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)NC1=NC(=NN1)SCC2=CC=CC=C2

InChI

InChI=1S/C10H12N4O2S2/c1-18(15,16)14-9-11-10(13-12-9)17-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,11,12,13,14)